MMs02499870 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 69 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2529 -1.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7529 -1.2905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5059 -2.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7588 -3.8886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2588 -3.8920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5059 -2.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0059 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5118 -5.1927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0118 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0059 -2.5844 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4059 -3.6237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7588 -3.8818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0118 -5.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7647 -6.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2647 -6.4764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0118 -5.1757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2588 -3.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0059 -2.5776 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6059 -3.6169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2529 -1.2803 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4120 -0.9697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7529 -1.2837 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5938 -0.9731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2862 0.1418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8585 0.6021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4977 1.0263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7132 0.1473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5059 -2.5742 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1082 -3.6121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2529 -1.2735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 0.0238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7529 -1.2701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5059 -2.5674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0059 -2.5640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7529 -1.2633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 0.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7470 1.3348 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 14.9941 2.6321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2470 1.3382 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.7315 -7.9020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5200 -8.7864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3044 -7.9075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0027 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0027 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3506 -0.2499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3612 -4.9265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5965 -1.5602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0091 -3.9961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1882 -5.1989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0145 -6.3961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8118 -5.1852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2118 -5.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8106 -0.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3109 1.1879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9082 -3.6080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6082 -3.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9529 -1.2605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8976 1.0685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3250 -9.6763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7190 -9.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 11 52 1 0 0 0 0 11 53 1 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 59 1 0 0 0 0 36 37 1 0 0 0 0 36 60 1 0 0 0 0 37 38 2 0 0 0 0 37 61 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 39 62 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 44 63 1 0 0 0 0 44 64 1 0 0 0 0 M CHG 1 40 1 M CHG 1 42 -1 M END